C26H21ClN4O2S
methyl 8-(4-chlorophenyl)-4-(4-methylphenyl)-10-phenyl-1-thia-3,4,9,10-tetrazaspiro[4.5]deca-2,6,8-triene-2-carboxylate
Also Known As: methyl 8-(4-chlorophenyl)-1-(4-methylphenyl)-10-phenyl-4-thia-1,2,9,10-tetrazaspiro[4.5]deca-2,6,8-triene-3-carboxylate|methyl 8-(4-chlorophenyl)-1-(4-methylphenyl)-6-phenyl-4-thia-1,2,6,7-tetraazaspiro[4.5]deca-2,7,9-triene-3-carboxylate|methyl 8-(4-chlorophenyl)-6-phenyl-1-(p-tolyl)-4-thia-1,2,6,7-tetraazaspiro[4.5]deca-2,7,9-triene-3-carboxylate
CAS: 668446-31-9
| Molecular Formula | C26H21ClN4O2S |
|---|---|
| Molecular Weight | 488.10736 g/mol |
| LogP | 5.82262 |
| Topological Polar Surface Area | 57.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 4 |
| Exact Mass | 488.10736 |
| Monoisotopic Mass | 488.10736 |
| Heavy Atoms | 34 |
| Complexity | 1306.892 |
Chemical Identifiers
| CAS Number | 668446-31-9 |
|---|---|
| SMILES | CC1=CC=C(C=C1)N2C3(C=CC(=NN3C4=CC=CC=C4)C5=CC=C(C=C5)Cl)SC(=N2)C(=O)OC |
Product Overview
C26H21ClN4O2S (CAS 668446-31-9), with molecular formula C26H21ClN4O2S and molecular weight 488.10736 g/mol. IUPAC: methyl 8-(4-chlorophenyl)-4-(4-methylphenyl)-10-phenyl-1-thia-3,4,9,10-tetrazaspiro[4.5]deca-2,6,8-triene-2-carboxylate.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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